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Merge pull request #40 from lammpstutorials/improve-tutorial-7
clean tutorial 7
2 parents 0805df1 + d26b11b commit 25c83fd

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figures/US-density-evolution.png

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figures/US-density.png

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figures/US-free-energy.png

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figures/US-potential.png

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figures/US-system-biased.png

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figures/US-system-unbiased.png

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files/tutorial7/.manifest

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# LAMMPS Tutorial manifest file. This file determines what is downloaded when.
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# comments start with a # as the first character.
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# comments and empty lines are ignored
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##############################################################################
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# 1) input file templates and data files
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# the first file will be automatically loaded
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free-sampling.lmp
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umbrella-sampling.meta
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umbrella-sampling.lmp
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wham
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# 2) solution files
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# only downloaded on request
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free-sampling.dat
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free-sampling.lmp
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free-sampling.log
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free-sampling.png
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umbrella-sampling.dat
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umbrella-sampling.lmp
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umbrella-sampling.log
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umbrella-sampling.png
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wham
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umbrella-sampling.meta
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# 3) support files
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files/tutorial7/free-sampling.lmp

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variable sigma equal 3.405
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variable epsilon equal 0.238
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variable U0 equal 1.5*${epsilon}
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variable dlt equal 1.0
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variable x0 equal 10.0
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units real
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atom_style atomic
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pair_style lj/cut 3.822
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pair_modify shift yes
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boundary p p p
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files/tutorial7/metadata.dat

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files/tutorial7/solution/free-sampling.dat

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